Substrate
/
Generation 1
/
Generation 2
XenoSite
Adenosine
Nc1ncnc2c1ncn2C1OC(CO)C(O)C1O
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
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NC1=c2ncn(C3OC(CO)C(O)C3O)c2=NC2ON12
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
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N=C1C(=C(N)N2OC2=O)N=CN1C1OC(CO)C(O)C1O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 3
Select a metabolite to form the next generation.
hydrolysis
Probability 0.26
0.26
hydrolysis
Probability 0.26
0.26
dealkylation
Probability 0.17
0.17
dealkylation
Probability 0.17
0.17
(3<i>s</i>,4<i>r</i>,5<i>r</i>)-3,4-dihydroxy-5-(hydroxymethyl)dihydro-2(3<em>h</em>)-furanone
dealkylation
Probability 0.17
0.17
Beta-l-lyxo-pentofuranose
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